SCHEMBL3750819

SCHEMBL3750819

CNC(=O)C1c2ccccc2C(=O)N1Cc1ccccc1C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.60
THRB P10828 1/20 0.57
KCNA5 P22460 2/20 0.54
KCNH2 Q12809 2/20 0.54
NPSR1 Q6W5P4 1/20 0.53
MCHR1 Q99705 1/20 0.53
F2 P00734 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 2/20 0.52
TSHR P16473 2/20 0.51
ALDH1A1 P00352 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3760181 0.89 TP53 (0.56) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3755342 0.89 MAPT (0.57) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3751580 0.89 KCNA5 (0.52) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3750226 0.81 KCNA5 (0.57) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3756958 0.73 KCNA5 (0.72) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3758090 0.73 KCNA5 (0.55) TP53THRBKCNA5KCNH2NPSR1
SCHEMBL3753558 0.72 MAPT (0.49) TP53THRBKCNA5NPSR1MCHR1
SCHEMBL3751657 0.71 KCNA5 (0.74) THRBKCNA5KCNH2ALDH1A1
SCHEMBL4363815 0.71 KCNA5 (0.58) TP53THRBKCNA5KCNH2ALDH1A1
SCHEMBL3756564 0.71 TP53 (0.77) TP53THRBNPSR1MCHR1F2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US claimed
EP-2049484-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS AstraZeneca AB (SE) 2009-04-22 EP claimed
WO-2008008022-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS ASTRAZENECA AB (SE) 2008-01-17 WO claimed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 US claimed
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US disclosed
EP-2049484-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS AstraZeneca AB (SE) 2009-04-22 EP disclosed
WO-2008008022-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS ASTRAZENECA AB (SE) 2008-01-17 WO disclosed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080015237-A1 NEW COMPOUNDS I/418 KCNH1, KCNH2, KCNH3 TP53 3912/4885THRB 1799/4885KCNA5 69/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 TP53 3602/4885THRB 1412/4885KCNA5 72/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.